| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2011 | 30 | Yes |
Popular Name: 4-[[5-(4-isopropylphenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzoic 4-[[5-(4-isopropylphenyl)-4-oxo-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 6.96 | 12.5 | -59.75 | 1 | 5 | -1 | 86 | 435.55 | 6 | ↓ |
| Mid Mid (pH 6-8) | 7.42 | 11.28 | -99.85 | 0 | 5 | -2 | 89 | 434.542 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/13361.gif)
![2-(benzylthio)-5-phenyl-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/27361.gif)